(4-methylphenyl)-[(2S)-2-[2-(phenylsulfonyl)ethyl]piperidin-1-yl]methanone

Systemtic Name: (4-methylphenyl)-[(2S)-2-[2-(phenylsulfonyl)ethyl]piperidin-1-yl]methanone Openeye Name: [(2S)-2-[2-(benzenesulfonyl)ethyl]-1-piperidyl]-(p-tolyl)methanone CAS Name: [(2S)-2-[2-(benzenesulfonyl)ethyl]-1-piperidinyl]-(4-methylphenyl)methanone IUPAC Name: [(2S)-2-[2-(benzenesulfonyl)ethyl]piperidin-1-yl]-(4-methylphenyl)methanone Traditional Name: [(2S)-2-(2-besylethyl)piperidino]-(p-tolyl)methanone Formula: C21H25NO3S MolecularWeight: 371.4931

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N2CCCCC2CCS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2CCCC[C@H]2CCS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H25NO3S/c1-17-10-12-18(13-11-17)21(23)22-15-6-5-7-19(22)14-16-26(24,25)20-8-3-2-4-9-20/h2-4,8-13,19H,5-7,14-16H2,1H3/t19-/m0/s1